Cas no 85187-50-4 (2,2-dimethylpropane-1,3-diyl methylcyclohex-4-ene-1,2-dicarboxylate)
85187-50-4 structure
Product Name:2,2-dimethylpropane-1,3-diyl methylcyclohex-4-ene-1,2-dicarboxylate
CAS No:85187-50-4
MF:C14H20O4
MW:252.306204795837
CID:887294
PubChem ID:44150272
Update Time:2025-04-19
2,2-dimethylpropane-1,3-diyl methylcyclohex-4-ene-1,2-dicarboxylate Chemical and Physical Properties
Names and Identifiers
-
- 2,2-dimethylpropane-1,3-diyl methylcyclohex-4-ene-1,2-dicarboxylate
- 4,4,7a-trimethyl-5,8,11,11a-tetrahydro-3H-2,6-benzodioxonine-1,7-dione
- 4,4,7a-Trimethyl-4,5,7a,8,11,11a-hexahydro-3H-2,6-benzodioxonine-1,7-dione
- EINECS 286-141-0
- DTXSID501005652
- 85187-50-4
-
- Inchi： 1S/C14H20O4/c1-13(2)8-17-11(15)10-6-4-5-7-14(10,3)12(16)18-9-13/h4-5,10H,6-9H2,1-3H3
- InChI Key： KTUZUPSQYOXSOR-UHFFFAOYSA-N
- SMILES： O1CC(C)(C)COC(C2CC=CCC2(C1=O)C)=O
Computed Properties
- Exact Mass: 252.136
- Monoisotopic Mass: 252.136
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 0
- Complexity: 397
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 52.6A^2
- XLogP3: 2.4
Experimental Properties
- Boiling Point: 592.5°C at 760 mmHg
- Flash Point: 197.4°C
2,2-dimethylpropane-1,3-diyl methylcyclohex-4-ene-1,2-dicarboxylate Related Literature
-
Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
85187-50-4 (2,2-dimethylpropane-1,3-diyl methylcyclohex-4-ene-1,2-dicarboxylate) Related Products
- 2611-00-9(1-Cyclohex-3-enylmethylcyclohex-3-ene-1-carboxylate)
- 19321-40-5(9-Octadecenoic acid(9Z)-, 1,1'-[2,2-bis[[[(9Z)-1-oxo-9-octadecenyl]oxy]methyl]-1,3-propanediyl]ester)
- 26590-20-5(Methyltetrahydrophthalic anhydride)
- 5048-50-0(Diethyl trans-4-Cyclohexene-1,2-dicarboxylate)
- 25151-96-6(9-Octadecenoic acid(9Z)-, 1,1'-[2,2-bis(hydroxymethyl)-1,3-propanediyl] ester)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
Recommended suppliers
ASIACHEM I&E (JIANGSU) CO., LTD
Gold Member
Audited Supplier
CN Supplier
Bulk
Jiangxi Boyang Pharmaceutical Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Jiangsu Xinsu New Materials Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Shandong Jing Kun Chemical Co.,Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk